Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:02:12 UTC
Update Date2025-03-21 22:07:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00490418
Frequency3.5
Structure
Chemical FormulaC5H8N2OS
Molecular Mass144.0357
SMILESCC(=O)NC(C#N)CS
InChI KeyQQNQCUUIFKPJLF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent acetamides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • nitriles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • nitrile
  • organosulfur compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • carbonitrile
  • alkylthiol
  • acetamide
  • organooxygen compound